Cabazitaxel
TL;DR: Cabazitaxel (CAS 890654-44-1) is a chemical compound with molecular formula C45H57NO14 and molecular weight 835.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1-hydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-9,12-dimethoxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Also Known As: CABAZITAXEL, Jevtana, Cabazitaxelum, kabazitaxel, Taxoid XRP6258
| Molecular Formula | C45H57NO14 |
|---|---|
| Molecular Weight | 835.38 g/mol |
| LogP | 4.5678 |
| Topological Polar Surface Area | 202.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 835.3779 |
| Heavy Atoms | 60 |
| Complexity | 2011.5656 |
Chemical Identifiers
| CAS Number | 890654-44-1 |
|---|---|
| SMILES | CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)OC)C)OC |
Product Overview
Cabazitaxel (CAS 890654-44-1), with molecular formula C45H57NO14 and molecular weight 835.38 g/mol. IUPAC: [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1-hydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-9,12-dimethoxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate.
Chemical Property Profile of Cabazitaxel
Property Insights of Cabazitaxel
The XLogP value of 4.5678 indicates that Cabazitaxel is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 202.45 Ų indicates high polarity, suggesting Cabazitaxel may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cabazitaxel has 3 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cabazitaxel?
The CAS number of Cabazitaxel is 890654-44-1.
What is the molecular formula of Cabazitaxel?
The molecular formula of Cabazitaxel is C45H57NO14.
What is the molecular weight of Cabazitaxel?
The molecular weight of Cabazitaxel is 835.38 g/mol.
Where can I buy Cabazitaxel?
You can request a quote for Cabazitaxel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cabazitaxel?
Yes, KEHONG BIO provides custom synthesis services for Cabazitaxel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.